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首发于Mechanism Hub 切换模式写文章 登录/注册人工智能逆合成分析--IBM RXN API ABChemD 药化/药物设计/网页应用部署爱好者12 人赞同了该文章 IBM RXN is a platform supported by Artificial Intelligence. --- IBM 网站引用 如果你对免费逆合成分析感兴趣,也可参考我的另一篇blog 懒人逆合成分析—AiZynth...
importtorchfromrxnscribeimportRxnScribefromhuggingface_hubimporthf_hub_downloadckpt_path=hf_hub_download("yujieq/RxnScribe","pix2seq_reaction_full.ckpt")model=RxnScribe(ckpt_path,device=torch.device('cpu'))image_file="assets/jacs.5b12989-Table-c3.png"predictions=model.predict_image_file(image_fi...
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cd ChemRxnExtractor pip install -r requirements.txt pip install -e . Download Trained Models Download the trained models:cre_models_v0.1.tgz, and extract to the current directory: tar zxvf cre_models_v0.1.tgz Usage Using RxnExtractor in your code: ...
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